MD-kernel (baseline version)

Version's name: MD-kernel (baseline version) ; a version of the MD-kernel program.
Repository: [home] and version downloads: [.zip] [.tar.gz] [.tar.bz2] [.tar]

This version is a baseline implementation of the Lennard Jones potential evaluation.

Pre-requisites

To build an execute the program, you require a C++ compiler with an OpenMP runtime.

Building the kernel

In order to build the program you should execute the make program:

$> make

Executing the kernel

Please execute the binary as follows to set active thread count and affinity.

$> OMP_NUM_THREADS=xx OMP_SCHEDULE=xx OMP_PLACES=cores OMP_PROC_BIND=close ./md_cell